SCHEMBL16482685

SCHEMBL16482685

c1ccc(-c2ccc3oc4c([nH]c5ccc6ccccc6c54)c3c2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CDK4 P11802 6/20 0.47
▸ CCND1 P24385 6/20 0.47
▸ ABCG2 Q9UNQ0 3/20 0.44
▸ PAX8 Q06710 2/20 0.44
▸ CYP1A1 P04798 1/20 0.44
▸ CYP1A2 P05177 1/20 0.44
▸ FYN P06241 1/20 0.44
▸ MAPK3 P27361 1/20 0.44
▸ AHR P35869 1/20 0.44
▸ CCNB2 O95067 1/20 0.41
▸ CCNE2 O96020 1/20 0.41
▸ CDK1 P06493 1/20 0.41
▸ CCNB1 P14635 1/20 0.41
▸ CCNE1 P24864 1/20 0.41
▸ CDK2 P24941 1/20 0.41
▸ CCNB3 Q8WWL7 1/20 0.41
▸ PIM1 P11309 1/20 0.41
▸ CSNK2A2 P19784 1/20 0.41
▸ CSNK2B P67870 1/20 0.41
▸ PIM3 Q86V86 1/20 0.41

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL19544035 0.86 CDK4 (0.47) CDK4CCND1ABCG2PAX8CYP1A1
SCHEMBL16482722 0.84 TDP1 (0.45) CDK4CCND1ABCG2CCNB2CCNE2
SCHEMBL16482644 0.81 KIF11 (0.44) CDK4CCND1ABCG2PAX8CYP1A1
SCHEMBL16482705 0.81 KIF11 (0.46) ABCG2PAX8CYP1A1CYP1A2FYN
SCHEMBL16482458 0.80 KDM4E (0.46) CDK4CCND1PIM1CSNK2A2CSNK2B
SCHEMBL16482671 0.79 PLA2G2A (0.44) PIM1CSNK2A2CSNK2BPIM3PIM2
SCHEMBL16543091 0.78 ABCG2 (0.54) ABCG2PAX8CYP1A1CYP1A2FYN
SCHEMBL22708477 0.78 KIF11 (0.44) CDK4CCND1ABCG2PAX8CYP1A1
SCHEMBL17299513 0.78 CDK4 (0.43) CDK4CCND1PIM1CSNK2A2CSNK2B
SCHEMBL25638316 0.77 CDK4 (0.54) CDK4CCND1ABCG2PAX8CYP1A1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2014058183-A1 COMPOUND FOR ORGANIC ELECTRONIC DEVICE, ORGANIC ELECTRONIC DEVICE USING SAME, AND ELECTRONIC APPARATUS OF SAID ORGANIC ELECTRONIC DEVICE 덕산하이메탈(주) (KR) 2014-04-17 — — WO disclosed
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